Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 8/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.34 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4119451 | 0.91 | CYP2C9 (0.46) | MAPK14CYP2C9CYP2C19JAK2JAK1 | |
| SCHEMBL13798659 | 0.86 | CYP2C9 (0.38) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL13561281 | 0.84 | CYP2C9 (0.50) | MAPK14CYP2C9CYP2C19JAK2JAK1 | |
| SCHEMBL13798616 | 0.84 | CYP2C9 (0.43) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL13798619 | 0.83 | CYP2C9 (0.44) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL11947247 | 0.79 | CYP2C9 (0.39) | CYP2C9CYP2C19KCNH2ABCC3ESR1 | |
| SCHEMBL4105959 | 0.79 | CYP2C9 (0.46) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL13561396 | 0.78 | CYP2C19 (0.46) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL4100849 | 0.77 | CYP2C9 (0.49) | CYP2C9CYP2C19JAK2JAK1TYK2 | |
| SCHEMBL10256174 | 0.77 | ADORA1 (0.37) | MAPK14CYP2C9CYP2C19JAK2JAK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009079412-A2 | REVERSE TRANSCRIPTASE INHIBITORS | ARDEA BIOSCIENCES INC. (US) | 2009-06-25 | — | — | WO | disclosed |